2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile

C20H17N3 — CID 3351973

IUPAC2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile
SMILESCc1ccc(C)c(-c2cc(-c3ccccc3)nc(N)c2C#N)c1
InChIInChI=1S/C20H17N3/c1-13-8-9-14(2)16(10-13)17-11-19(15-6-4-3-5-7-15)23-20(22)18(17)12-21/h3-11H,1-2H3,(H2,22,23)
InChIKeyDCQIQDYJUNZHIM-UHFFFAOYSA-N
MW299.38 g/mol
LogP4.49
Rot. Bonds2

About 2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile

2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile (PubChem CID 3351973) has the molecular formula C20H17N3 and a molecular weight of 299.38 g/mol. Its IUPAC name is 2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile
PubChem CID3351973
Molecular FormulaC20H17N3
Molecular Weight299.38 g/mol
Exact Mass299.14
IUPAC Name2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile
SMILESCc1ccc(C)c(-c2cc(-c3ccccc3)nc(N)c2C#N)c1
InChIInChI=1S/C20H17N3/c1-13-8-9-14(2)16(10-13)17-11-19(15-6-4-3-5-7-15)23-20(22)18(17)12-21/h3-11H,1-2H3,(H2,22,23)
InChIKeyDCQIQDYJUNZHIM-UHFFFAOYSA-N
XLogP4.49
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-4-(2,5-dimethylphenyl)-6-(2-methylphenyl)pyridine-3-carbonitrile
CID 5230497
2-amino-4,6-bis(2,5-dimethylphenyl)pyridine-3-carbonitrile
CID 3513608
2-amino-4-(2,5-dimethylphenyl)-6-(3-fluorophenyl)pyridine-3-carbonitrile
CID 5118538
2-amino-6-(4-bromophenyl)-4-(2,4-dimethylphenyl)pyridine-3-carbonitrile
CID 3396959
2-amino-6-(4-methylphenyl)-4-pyridin-2-ylpyridine-3-carbonitrile
CID 3365204
2-amino-6-(2,5-dimethylphenyl)-4-(4-propan-2-ylphenyl)pyridine-3-carbonitrile
CID 3506050
2-amino-4-(4-tert-butylphenyl)-6-phenylpyridine-3-carbonitrile
CID 3350002
2-amino-6-phenyl-4-(2,4,5-trimethoxyphenyl)pyridine-3-carbonitrile
CID 3353886
2-amino-4-(3-chlorophenyl)-6-(4-methylphenyl)pyridine-3-carbonitrile
CID 3825642
2-amino-4-(2-methoxyphenyl)-6-(4-phenylphenyl)pyridine-3-carbonitrile
CID 5231002
2-amino-6-(2,5-dimethylphenyl)-4-(5-methylthiophen-2-yl)pyridine-3-carbonitrile
CID 3517163
2-amino-6-(4-bromophenyl)-4-(3-methylphenyl)pyridine-3-carbonitrile
CID 3395709

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile?
The IUPAC name of 2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile (CID 3351973) is 2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile?
The canonical SMILES for 2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile is Cc1ccc(C)c(-c2cc(-c3ccccc3)nc(N)c2C#N)c1.
What is the InChIKey of 2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile?
The InChIKey is DCQIQDYJUNZHIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3/c1-13-8-9-14(2)16(10-13)17-11-19(15-6-4-3-5-7-15)23-20(22)18(17)12-21/h3-11H,1-2H3,(H2,22,23).
What are the key properties of 2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile?
2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile has a molecular weight of 299.38 g/mol, XLogP of 4.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile is sourced from PubChem (CID 3351973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).